Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL307459 | 0.73 | MAOA (0.34) | MAOAMAOB | |
| SCHEMBL27786483 | 0.69 | MAOA (0.31) | MAOAMAOBATM | |
| SCHEMBL5921179 | 0.68 | CYP2C9 (0.38) | ALDH1A1MAOAMAOBATM | |
| SCHEMBL5473567 | 0.67 | ATM (0.47) | ALDH1A1MAOAMAOBATM | |
| SCHEMBL5585840 | 0.67 | ATM (0.36) | ALDH1A1MAOAMAOBATM | |
| SCHEMBL9226919 | 0.66 | MAOA (0.48) | ALDH1A1MAOAMAOBATM | |
| SCHEMBL5605786 | 0.65 | EGFR (0.36) | ALDH1A1MAOAMAOBATM | |
| SCHEMBL7988825 | 0.62 | CA2 (0.42) | ALDH1A1HSD17B10TDP1CA2 | |
| SCHEMBL1147690 | 0.60 | TRPA1 (0.34) | ALDH1A1HSD17B10TDP1CA2 | |
| SCHEMBL4327573 | 0.58 | CA1 (0.41) | ALDH1A1HSD17B10TDP1CA2MAOA |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009148659-A2 | ANTIMALARIAL QUINOLINES AND METHODS OF USE THEREOF | GEORGETOWN UNIVERSITY (US) | 2009-12-10 | — | — | WO | disclosed |